2,5-bis(oxidanyl)-1-phenyl-heptan-1-one

Systemtic Name: 2,5-bis(oxidanyl)-1-phenyl-heptan-1-one Openeye Name: 2,5-dihydroxy-1-phenyl-heptan-1-one CAS Name: 2,5-dihydroxy-1-phenyl-1-heptanone IUPAC Name: 2,5-dihydroxy-1-phenylheptan-1-one Traditional Name: 2,5-dihydroxy-1-phenyl-heptan-1-one Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C(=O)C1=CC=CC=C1)O)O

Isomeric SMILES

CCC(CCC(C(=O)C1=CC=CC=C1)O)O

InChI

InChI=1S/C13H18O3/c1-2-11(14)8-9-12(15)13(16)10-6-4-3-5-7-10/h3-7,11-12,14-15H,2,8-9H2,1H3